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Session Map (id=119-L8-696)

Interfaces in PDB 3e16 crystal.
Space symmetry group: P 21 21 21. Resolution: 1.60 Å

X-RAY STRUCTURE OF HUMAN PROSTASIN IN COMPLEX WITH BENZOXAZOLE WARHEAD PEPTIDOMIMIC, LYSINE IN P3

Interfaces

##		Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
NN	«»	Range	ⁱN_at	ⁱN_res	Surface Å²	×	Range	Symmetry op-n	Sym.ID	ⁱN_at	ⁱN_res	Surface Å²	interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
`1`		B	`66`	`20`	`11475`	`x`	B	x-1/2,-y+1/2,-z	`4_455`	`55`	`14`	`11475`	`587.5`	`-3.2`	`0.512`	`7`	`0`	`0`	`0.000`
`2`		[B4C]B:1	`43`	`1`	`938`	`cf`	B	x,y,z	`1_555`	`90`	`27`	`11475`	`568.0`	`-0.3`	`0.520`	`8`	`0`	`0`	`0.069`
`3`		B	`62`	`22`	`11475`	`x`	B	-x+1/2,-y+1,z-1/2	`2_564`	`63`	`17`	`11475`	`545.8`	`-2.5`	`0.538`	`7`	`6`	`0`	`0.000`
`4`		B	`52`	`23`	`11475`	`x`	B	x-1/2,-y+3/2,-z	`4_465`	`45`	`13`	`11475`	`478.3`	`-4.9`	`0.307`	`5`	`0`	`0`	`0.000`
`5`		B	`19`	`6`	`11475`	`f`	[GOL]B:2	x-1/2,-y+1/2,-z	`4_455`	`6`	`1`	`218`	`119.0`	`0.0`	`0.606`	`5`	`0`	`0`	`0.040`
`6`		[DMS]B:273	`4`	`1`	`214`	`◊`	B	x,y,z	`1_555`	`13`	`4`	`11475`	`94.7`	`2.7`	`0.507`	`0`	`0`	`0`	`0.000`
`7`		[DMS]B:273	`4`	`1`	`214`	`f`	B	x-1/2,-y+1/2,-z	`4_455`	`15`	`5`	`11475`	`79.5`	`0.5`	`0.405`	`0`	`0`	`0`	`0.000`
`8`		B	`11`	`7`	`11475`	`x`	B	-x+1,y-1/2,-z+1/2	`3_645`	`10`	`4`	`11475`	`71.6`	`-1.0`	`0.436`	`0`	`0`	`0`	`0.000`
`9`		B	`2`	`2`	`11475`	`◊`	[B4C]B:1	x-1/2,-y+3/2,-z	`4_465`	`2`	`1`	`938`	`20.3`	`-0.6`	`0.258`	`0`	`0`	`0`	`0.000`
`10`		[GOL]B:2	`1`	`1`	`218`	`◊`	B	x,y,z	`1_555`	`1`	`1`	`11475`	`10.7`	`0.2`	`0.648`	`0`	`0`	`0`	`0.000`
`11`		B	`3`	`1`	`11475`	`x`	B	-x,y-1/2,-z+1/2	`3_545`	`2`	`1`	`11475`	`9.0`	`0.1`	`0.626`	`0`	`0`	`0`	`0.000`

PDBe PISA v1.52 [20/10/2014]

Protein Data Bank
in Europe